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Home > Indoles and Oxindole > 933720-04-8
933720-04-8 | 2-[(piperazin-1-yl)methyl]-1H-indole
CAS No: 933720-04-8 Catalog No: AG01BXSA MDL No:MFCD16778385
Product Description
Catalog Number:
AG01BXSA
Chemical Name:
2-[(piperazin-1-yl)methyl]-1H-indole
CAS Number:
933720-04-8
Molecular Formula:
C13H17N3
Molecular Weight:
215.2942
MDL Number:
MFCD16778385
IUPAC Name:
2-(piperazin-1-ylmethyl)-1H-indole
InChI:
InChI=1S/C13H17N3/c1-2-4-13-11(3-1)9-12(15-13)10-16-7-5-14-6-8-16/h1-4,9,14-15H,5-8,10H2
InChI Key:
OVDSBRUMFDTCKF-UHFFFAOYSA-N
SMILES:
N1CCN(CC1)Cc1cc2c([nH]1)cccc2
Properties
Complexity:
225
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.142g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
215.3g/mol
Monoisotopic Mass:
215.142g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
31.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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